J. Tersoff
Applied Surface Science
Cluster model calculations suggest that the molecular orbitals of CO are significantly perturbed upon chemisorption on Ni. The CO-Ni interaction is found to involve the Ni-d electrons in addition to the s-and p-derived states, contrary to some earlier suggestions. Based on our results, a new interpretation is proposed for the observed photoemission spectra of CO on Ni, which is consistent with the large bonding and relaxation shifts in other systems. © 1975.
J. Tersoff
Applied Surface Science
A. Krol, C.J. Sher, et al.
Surface Science
P. Martensson, R.M. Feenstra
Journal of Vacuum Science and Technology A: Vacuum, Surfaces and Films
Zelek S. Herman, Robert F. Kirchner, et al.
Inorganic Chemistry